Geometry & MOs

Info

ID:	245341
PubChem CID:	99443589
Reduced:	N2O2C12H13 (2)
Stoich.:	A2B2C12D13 (2)
Weight, g/mol:	357.168856
ΔH_f, kcal/mol:	-131.31
Dipole, Da:	4.48
IP(EA), eV:	-8.67(-0.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(benzylcarbamoylamino)-N-[(3,5-dimethoxyphenyl)methyl]acetamide

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)[C@]2(C(=O)N(C(=O)N2)CC(=O)N3CCC[C@H]3C(=O)NC4=CC=CC=C4)C

DOS

IR

Vibrations